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2',3',5',6'-Tetradeuterogenistein [5,7-dihydroxy-3-(4-hydroxyphenyl-2,3,4,5-D4)-4H-1-benzopyran-4-one]
SpectraBase Compound ID CyTyRrI1RfD
InChI InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)11-7-20-13-6-10(17)5-12(18)14(13)15(11)19/h1-7,16-18H/i1D,2D,3D,4D
InChIKey TZBJGXHYKVUXJN-RHQRLBAQSA-N
Mol Weight 274.26 g/mol
Molecular Formula C15H6D4O5
Exact Mass 274.07793 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3MdNMwPFC3g
Name 2',3',5',6'-Tetradeuterogenistein [5,7-dihydroxy-3-(4-hydroxyphenyl-2,3,4,5-D4)-4H-1-benzopyran-4-one]
Alternate Name(s) 5,7-Dihydroxy-3-(2,3,5,6-tetradeuterio-4-hydroxyphenyl)-1-benzopyran-4-one 5,7-Dihydroxy-3-(2,3,5,6-tetradeuterio-4-hydroxyphenyl)chromen-4-one 5,7-Dihydroxy-3-(2,3,5,6-tetradeuterio-4-hydroxy-phenyl)chromen-4-one 5,7-bis(oxidanyl)-3-(2,3,5,6-tetradeuterio-4-oxidanyl-phenyl)chromen-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H6D4O5
InChI InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)11-7-20-13-6-10(17)5-12(18)14(13)15(11)19/h1-7,16-18H/i1D,2D,3D,4D
InChIKey TZBJGXHYKVUXJN-RHQRLBAQSA-N
Molecular Weight 274.264 g/mol
SMILES Oc1cc2OC=C(C(c2c(c1)O)=O)c1c(c(c(O)c(c1[D])[D])[D])[D]
SPLASH splash10-00di-0390000000-ac6d314a450e2a198ae2
Source of Spectrum AT-38-7290-4
Wiley ID 854001